Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: N-Desmethyl bosutinib
RN: 380843-81-2
UNII: 8870T6W3VG
InChIKey: WJNXCARNBUNEMQ-UHFFFAOYSA-N

Molecular Formula

  • C25-H27-Cl2-N5-O3

Molecular Weight

  • 516.4263
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • N-Desmethyl bosutinib

Synonyms

  • 3-Quinolinecarbonitrile, 4-((2,4-dichloro-5-methoxyphenyl)amino)6-methoxy-7-(3-(1-piperazinyl)propoxy))
  • Bosutinib metabolite M5
  • N-Desmethyl bosutinib
  • UNII-8870T6W3VG

Registry Numbers

CAS Registry Number

  • 380843-81-2

FDA UNII

  • 8870T6W3VG

System Generated Number

  • 0380843812

Structure Descriptors

InChI

1S/C25H27Cl2N5O3/c1-33-22-13-21(18(26)11-19(22)27)31-25-16(14-28)15-30-20-12-24(23(34-2)10-17(20)25)35-9-3-6-32-7-4-29-5-8-32/h10-13,15,29H,3-9H2,1-2H3,(H,30,31)

InChIKey

WJNXCARNBUNEMQ-UHFFFAOYSA-N

Smiles

COc1cc(Nc2c(cnc3cc(OCCCN4CCNCC4)c(OC)cc23)C#N)c(Cl)cc1Cl